SCHEMBL13645718

SCHEMBL13645718

CCOC(=O)C(CCn1cnc2c(Cl)nc(N)nc21)C(=O)OCC

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 17/20 0.51
HSP90AA1 P07900 16/20 0.51
HSP90B1 P14625 1/20 0.47
TRAP1 Q12931 1/20 0.47
HDAC6 Q9UBN7 2/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
CYP2C19 P33261 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28451668 0.95 HSP90AB1 (0.49) HSP90AB1HSP90AA1HSP90B1TRAP1HDAC6
SCHEMBL10917478 0.90 HSP90AB1 (0.50) HSP90AB1HSP90AA1HSP90B1TRAP1HDAC6
SCHEMBL4950742 0.89 HSP90AB1 (0.50) HSP90AB1HSP90AA1HSP90B1TRAP1HDAC6
SCHEMBL10917174 0.89 HSP90AB1 (0.52) HSP90AB1HSP90AA1HSP90B1TRAP1HDAC6
SCHEMBL10507394 0.88 HSP90AB1 (0.48) HSP90AB1HSP90AA1HSP90B1TRAP1HDAC6
SCHEMBL8649570 0.81 HSP90AB1 (0.55) HSP90AB1HSP90AA1HSP90B1TRAP1HDAC6
SCHEMBL30114962 0.81 KDM4E (0.67) HSP90AB1HSP90AA1HSP90B1TRAP1HDAC6
SCHEMBL3155583 0.81 KDM4E (0.67) HSP90AB1HSP90AA1HSP90B1TRAP1HDAC6
SCHEMBL6153979 0.81 HSP90AB1 (0.50) HSP90AB1HSP90AA1HSP90B1TRAP1HDAC6
SCHEMBL3156963 0.80 KDM4E (0.67) HSP90AB1HSP90AA1HDAC6CYP2C19

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101195622-A Process for the preparation of famciclovir FANGXIA ENTPR INF CONSULT CO (CN) 2008-06-11 CN claimed
CN-108314685-B Preparation method of 2-amino-6-chloro-9- (4-acetoxyl-3-acetoxymethyl butyl) purine 上药康丽(常州)药业有限公司 2020-08-25 CN disclosed
CN-108484605-B Preparation method of 2-amino-6-chloro-9- (4-acetoxyl-3-acetoxymethyl butyl) purine 上药康丽(常州)药业有限公司 2020-08-21 CN disclosed
CN-101233134-B Preparation of famciclovir and other purine derivatives ARROW INT LTD 2013-01-23 CN disclosed
US-7601835-B2 Preparation of famciclovir and other purine derivatives ARROW INTERNATIONAL LIMITED (MT) 2009-10-13 US disclosed
US-7601835-B2 Preparation of famciclovir and other purine derivatives ARROW INTERNATIONAL LIMITED (MT) 2009-10-13 US disclosed
CN-101233134-A Preparation of famciclovir and other purine derivatives ARROW INT LTD (MT) 2008-07-30 CN disclosed
CN-101195622-A Process for the preparation of famciclovir FANGXIA ENTPR INF CONSULT CO (CN) 2008-06-11 CN disclosed
CN-101195622-A Process for the preparation of famciclovir FANGXIA ENTPR INF CONSULT CO (CN) 2008-06-11 CN disclosed